6-thia-2-azaspiro[4.5]decane

C8H15NS — CID 105430848

IUPAC6-thia-2-azaspiro[4.5]decane
SMILESC1CCC2(CCNC2)SC1
InChIInChI=1S/C8H15NS/c1-2-6-10-8(3-1)4-5-9-7-8/h9H,1-7H2
InChIKeyBLDFFIVCGSVVDN-UHFFFAOYSA-N
MW157.28 g/mol
LogP1.64
Rot. Bonds

About 6-thia-2-azaspiro[4.5]decane

6-thia-2-azaspiro[4.5]decane (PubChem CID 105430848) has the molecular formula C8H15NS and a molecular weight of 157.28 g/mol. Its IUPAC name is 6-thia-2-azaspiro[4.5]decane.

Molecular Properties

Compound Name6-thia-2-azaspiro[4.5]decane
PubChem CID105430848
Molecular FormulaC8H15NS
Molecular Weight157.28 g/mol
Exact Mass157.09
IUPAC Name6-thia-2-azaspiro[4.5]decane
SMILESC1CCC2(CCNC2)SC1
InChIInChI=1S/C8H15NS/c1-2-6-10-8(3-1)4-5-9-7-8/h9H,1-7H2
InChIKeyBLDFFIVCGSVVDN-UHFFFAOYSA-N
XLogP1.64
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.28
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-thia-2-azaspiro[4.5]decane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-thia-2-azaspiro[4.5]decane?
The IUPAC name of 6-thia-2-azaspiro[4.5]decane (CID 105430848) is 6-thia-2-azaspiro[4.5]decane.
What is the SMILES notation for 6-thia-2-azaspiro[4.5]decane?
The canonical SMILES for 6-thia-2-azaspiro[4.5]decane is C1CCC2(CCNC2)SC1.
What is the InChIKey of 6-thia-2-azaspiro[4.5]decane?
The InChIKey is BLDFFIVCGSVVDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NS/c1-2-6-10-8(3-1)4-5-9-7-8/h9H,1-7H2.
What are the key properties of 6-thia-2-azaspiro[4.5]decane?
6-thia-2-azaspiro[4.5]decane has a molecular weight of 157.28 g/mol, XLogP of 1.64, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-thia-2-azaspiro[4.5]decane is sourced from PubChem (CID 105430848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).